N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-2-(4-methylphenyl)carbonyl-benzamide

Systemtic Name: N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-2-(4-methylphenyl)carbonyl-benzamide Openeye Name: N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-2-(4-methylbenzoyl)benzamide CAS Name: N-[4-[[4-(dimethylamino)-2-quinazolinyl]amino]cyclohexyl]-2-[(4-methylphenyl)-oxomethyl]benzamide IUPAC Name: N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-2-(4-methylbenzoyl)benzamide Traditional Name: N-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-2-p-toluoyl-benzamide Formula: C31H33N5O2 MolecularWeight: 507.62602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NC3CCC(CC3)NC4=NC5=CC=CC=C5C(=N4)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NC3CCC(CC3)NC4=NC5=CC=CC=C5C(=N4)N(C)C

InChI

InChI=1S/C31H33N5O2/c1-20-12-14-21(15-13-20)28(37)24-8-4-5-9-25(24)30(38)32-22-16-18-23(19-17-22)33-31-34-27-11-7-6-10-26(27)29(35-31)36(2)3/h4-15,22-23H,16-19H2,1-3H3,(H,32,38)(H,33,34,35)